carboxy-[2-(3-ethoxy-3-oxidanylidene-propyl)-5-methyl-pyrazol-3-yl]-dimethyl-azanium

Systemtic Name: carboxy-[2-(3-ethoxy-3-oxidanylidene-propyl)-5-methyl-pyrazol-3-yl]-dimethyl-azanium Openeye Name: carboxy-[2-(3-ethoxy-3-oxo-propyl)-5-methyl-pyrazol-3-yl]-dimethyl-ammonium CAS Name: carboxy-[2-(3-ethoxy-3-oxopropyl)-5-methyl-3-pyrazolyl]-dimethylammonium IUPAC Name: carboxy-[2-(3-ethoxy-3-oxopropyl)-5-methylpyrazol-3-yl]-dimethylazanium Traditional Name: carboxy-[2-(3-ethoxy-3-keto-propyl)-5-methyl-pyrazol-3-yl]-dimethyl-ammonium Formula: C12H20N3O4+ MolecularWeight: 270.3049

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C(=CC(=N1)C)[N+](C)(C)C(=O)O

Isomeric SMILES

CCOC(=O)CCN1C(=CC(=N1)C)[N+](C)(C)C(=O)O

InChI

InChI=1S/C12H19N3O4/c1-5-19-11(16)6-7-14-10(8-9(2)13-14)15(3,4)12(17)18/h8H,5-7H2,1-4H3/p+1